1,7-bis(4-chlorophenyl)-4-(4-chlorophenyl)carbonyl-3,5-dipyridin-3-yl-heptane-1,7-dione

Systemtic Name: 1,7-bis(4-chlorophenyl)-4-(4-chlorophenyl)carbonyl-3,5-dipyridin-3-yl-heptane-1,7-dione Openeye Name: 4-(4-chlorobenzoyl)-1,7-bis(4-chlorophenyl)-3,5-bis(3-pyridyl)heptane-1,7-dione CAS Name: 1,7-bis(4-chlorophenyl)-4-[(4-chlorophenyl)-oxomethyl]-3,5-bis(3-pyridinyl)heptane-1,7-dione IUPAC Name: 4-(4-chlorobenzoyl)-1,7-bis(4-chlorophenyl)-3,5-dipyridin-3-ylheptane-1,7-dione Traditional Name: 4-(4-chlorobenzoyl)-1,7-bis(4-chlorophenyl)-3,5-bis(3-pyridyl)heptane-1,7-dione Formula: C36H27Cl3N2O3 MolecularWeight: 641.97018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(CC(=O)C2=CC=C(C=C2)Cl)C(C(CC(=O)C3=CC=C(C=C3)Cl)C4=CN=CC=C4)C(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC(=CN=C1)C(CC(=O)C2=CC=C(C=C2)Cl)C(C(CC(=O)C3=CC=C(C=C3)Cl)C4=CN=CC=C4)C(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C36H27Cl3N2O3/c37-28-11-5-23(6-12-28)33(42)19-31(26-3-1-17-40-21-26)35(36(44)25-9-15-30(39)16-10-25)32(27-4-2-18-41-22-27)20-34(43)24-7-13-29(38)14-8-24/h1-18,21-22,31-32,35H,19-20H2